SCHEMBL1493250

SCHEMBL1493250

COc1ccc(C(=O)c2ccc(OC)c(OC)c2)cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 1.00
TSHR P16473 2/20 1.00
CYP2C19 P33261 2/20 1.00
CYP3A4 P08684 1/20 1.00
CYP2C9 P11712 1/20 1.00
ALDH1A1 P00352 3/20 0.81
GAA P10253 2/20 0.81
CA12 O43570 1/20 0.73
CA1 P00915 1/20 0.73
CA2 P00918 1/20 0.73
CA4 P22748 1/20 0.73
CA6 P23280 1/20 0.73
CA7 P43166 1/20 0.73
TPMT P51580 1/20 0.73
CA9 Q16790 1/20 0.73
CA14 Q9ULX7 1/20 0.73
SLC22A6 Q4U2R8 1/20 0.70
SLC22A8 Q8TCC7 1/20 0.70
LMNA P02545 1/20 0.68
HTT P42858 1/20 0.68

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9364577 0.98 CYP1A2 (0.96) CYP1A2TSHRCYP2C19CYP3A4CYP2C9
SCHEMBL4818731 0.90 ALDH1A1 (1.00) CYP1A2TSHRCYP2C19CYP3A4CYP2C9
SCHEMBL6872165 0.90 TSHR (0.81) CYP1A2TSHRCYP2C19CYP3A4CYP2C9
SCHEMBL5074372 0.90 CYP1A2 (0.81) CYP1A2TSHRCYP2C19CYP3A4CYP2C9
SCHEMBL2601961 0.90 CYP1A2 (0.81) CYP1A2TSHRCYP2C19CYP3A4CYP2C9
SCHEMBL31369135 0.90 CYP1A2 (0.81) CYP1A2TSHRCYP2C19CYP3A4CYP2C9
SCHEMBL7369813 0.90 SLC22A6 (0.89) CYP1A2TSHRCYP2C19CYP3A4CYP2C9
SCHEMBL1333620 0.90 CYP1A2 (0.81) CYP1A2TSHRCYP2C19CYP3A4CYP2C9
SCHEMBL4824662 0.90 CYP1A2 (0.81) CYP1A2TSHRCYP2C19CYP3A4CYP2C9
SCHEMBL12402407 0.89 CYP1A2 (0.79) CYP1A2TSHRCYP2C19CYP3A4CYP2C9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 284 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102020546-B PTP1B inhibitor and preparation and application in preparing drug for treating type 2 diabetes mellitus thereof INST OCEANOLOGY CHINESE ACAD 2013-07-24 CN claimed
CN-102100685-B PTP1B inhibitor and synthetic method and application thereof INST OCEANOLOGY CHINESE ACAD 2012-12-26 CN claimed
CN-102020547-B PTP1B (Protein Tyrosine Phosphatase 1B) inhibitor as well as chemical synthesis method and application thereof INST OCEANOLOGY CHINESE ACAD 2012-09-19 CN claimed
CN-102020545-B PTP1B inhibitor, synthesis and application thereof INST OCEANOLOGY CHINESE ACAD 2012-09-12 CN claimed
CN-102020539-B PTP1B (Protein Tyrosine Phosphatase 1B) inhibitor, synthesis and application thereof in preparation of drugs for treating type 2 diabetes mellitus INST OCEANOLOGY CHINESE ACAD 2012-09-12 CN claimed
CN-102020541-B Protein tyrosine phosphatase 1B (PTP1B) inhibitor as well as chemical synthesis method and application thereof INST OCEANOLOGY CHINESE ACAD 2012-09-12 CN claimed
CN-102020538-B PTP1B (Protein Tyrosine Phosphatase 1B) inhibitor as well as synthesis method and application thereof to preparation of type 2 diabetes medicament INST OCEANOLOGY CHINESE ACAD 2012-07-25 CN claimed
CN-101597213-B Chemical synthesis method of bromphenol PTP1B inhibitor INST OCEANOLOGY CHINESE ACAD 2012-07-04 CN claimed
CN-102100685-A PTP1B inhibitor and synthetic method and application thereof INST OCEANOLOGY CHINESE ACAD 2011-06-22 CN claimed
CN-102101825-A PTP1B (Protein Tyrosine Phosphatase 1B) inhibitor, and synthesis and application thereof INST OCEANOLOGY CHINESE ACAD 2011-06-22 CN claimed
CN-102020547-A PTP1B (Protein Tyrosine Phosphatase 1B) inhibitor as well as chemical synthesis method and application thereof INST OF OCEANOLOGY OF CHINESE ACADEMY OF SCIENCES 2011-04-20 CN claimed
CN-102020538-A PTP1B (Protein Tyrosine Phosphatase 1B) inhibitor as well as synthesis method and application thereof to preparation of type 2 diabetes medicament INST OF OCEANOLOGY OF CHINESE ACADEMY OF SCIENCES 2011-04-20 CN claimed
CN-102020537-A Protein tyrosine phosphatase 1B (PTP1B) inhibitor, and synthesis and application thereof INST OF OCEANOLOGY OF CHINESE ACADEMY OF SCIENCES 2011-04-20 CN claimed
CN-102020541-A Protein tyrosine phosphatase 1B (PTP1B) inhibitor as well as chemical synthesis method and application thereof INST OF OCEANOLOGY OF CHINESE ACADEMY OF SCIENCES 2011-04-20 CN claimed
CN-102020546-A PTP1B inhibitor and preparation and application in preparing drug for treating type 2 diabetes mellitus thereof INST OF OCEANOLOGY OF CHINESE ACADEMY OF SCIENCES 2011-04-20 CN claimed
CN-101597213-A A kind of chemical synthesis process of bromphenol PTP 1 B inhibitor INST OCEANOLOGY CHINESE ACAD (CN) 2009-12-09 CN claimed
CN-101597217-A PTP1B inhibitor and application synthetic and in preparation diabetes B medicine INST OCEANOLOGY CHINESE ACAD (CN) 2009-12-09 CN claimed
CN-101597216-A Bromo PTP1B inhibitor reaches synthetic and uses in the preparation diabetes medicament INST OCEANOLOGY CHINESE ACAD (CN) 2009-12-09 CN claimed
US-6011178-A Process for the preparation of 2-amino-4,5,3',4'-tetramethoxybenzophenone LONZA, LTD. (CH) 2000-01-04 US claimed
EP-0941987-A1 Process for the preparation of 2-Amino-4,5,3',4'-tetramethoxybenzophenone LONZA A.G. (CH) 1999-09-15 EP claimed